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Details

Stereochemistry ACHIRAL
Molecular Formula C8H5O7S.Na
Molecular Weight 268.176
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MONOSODIUM 5-SULFOISOPHTHALATE

SMILES

[Na+].OC(=O)C1=CC(=CC(=C1)C(O)=O)S([O-])(=O)=O

InChI

InChIKey=YXTFRJVQOWZDPP-UHFFFAOYSA-M
InChI=1S/C8H6O7S.Na/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C8H5O7S
Molecular Weight 245.186
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:09:39 UTC 2023
Edited
by admin
on Fri Dec 15 19:09:39 UTC 2023
Record UNII
5I79J6MURZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MONOSODIUM 5-SULFOISOPHTHALATE
Systematic Name English
1,3-BENZENEDICARBOXYLIC ACID, 5-SULFO-, MONOSODIUM SALT
Common Name English
SODIUM HYDROGEN-5-SULPHOISOPHTHALATE
Common Name English
DELION HS
Common Name English
1,3-BENZENEDICARBOXYLIC ACID, 5-SULFO-, SODIUM SALT (1:1)
Common Name English
MONOSODIM 5-SULFOISOPHTHALATE
Common Name English
ISOPHTHALIC ACID, 5-SULFO-, MONOSODIUM SALT
Common Name English
BENZENESULFONIC ACID, 3,5-DICARBOXY-, SODIUM SALT
Common Name English
Classification Tree Code System Code
Food Contact Sustance Notif, (FCN No.) FCN NO. 1175
Created by admin on Fri Dec 15 19:09:39 UTC 2023 , Edited by admin on Fri Dec 15 19:09:39 UTC 2023
Food Contact Sustance Notif, (FCN No.) FCN NO. 144
Created by admin on Fri Dec 15 19:09:39 UTC 2023 , Edited by admin on Fri Dec 15 19:09:39 UTC 2023
Code System Code Type Description
ECHA (EC/EINECS)
228-845-2
Created by admin on Fri Dec 15 19:09:39 UTC 2023 , Edited by admin on Fri Dec 15 19:09:39 UTC 2023
PRIMARY
PUBCHEM
23670844
Created by admin on Fri Dec 15 19:09:39 UTC 2023 , Edited by admin on Fri Dec 15 19:09:39 UTC 2023
PRIMARY
EPA CompTox
DTXSID9029279
Created by admin on Fri Dec 15 19:09:39 UTC 2023 , Edited by admin on Fri Dec 15 19:09:39 UTC 2023
PRIMARY
CAS
6362-79-4
Created by admin on Fri Dec 15 19:09:39 UTC 2023 , Edited by admin on Fri Dec 15 19:09:39 UTC 2023
PRIMARY
FDA UNII
5I79J6MURZ
Created by admin on Fri Dec 15 19:09:39 UTC 2023 , Edited by admin on Fri Dec 15 19:09:39 UTC 2023
PRIMARY